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Butanedioic acid, 2-bromo-3-ethyl-, 4-methyl ester, [S-(R,S)]- (9CI)

Butanedioic acid, 2-bromo-3-ethyl-, 4-methyl ester, [S-(R*,S*)]- (9CI) structure

CAS No:
146499-97-0
Formula:
C7H11BrO4
Chemical Name:
Butanedioic acid, 2-bromo-3-ethyl-, 4-methyl ester, [S-(R*,S*)]- (9CI)
Synonyms:
Butanedioic acid, 2-bromo-3-ethyl-, 4-methyl ester, [S-(R*,S*)]- (9CI)

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Butanedioic acid, 2-bromo-3-ethyl-, 4-methyl ester, [S-(R,S)]- (9CI) Basic Attributes

Molecular Weight：

239.06384

Exact Mass：

237.984

Characteristics

PSA：

63.6

XLogP3：

1.4

Density：

1.531±0.06 g/cm3(Predicted)

Boiling Point：

293.6±25.0 °C(Predicted)

Computed Properties

Molecular Weight:239.06
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:237.98407
Monoisotopic Mass:237.98407
Topological Polar Surface Area:63.6
Heavy Atom Count:12
Complexity:180
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Butanedioic acid, 2-bromo-3-ethyl-, 4-methyl ester, [S-(R*,S*)]- (9CI)

Basic Attributes
Characteristics
Computed Properties
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Butanedioic acid, 2-bromo-3-ethyl-, 4-methyl ester, [S-(R*,S*)]- (9CI)

SDS

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